(phenylmethyl) (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-hydroxy-propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-hydroxy-1-oxopropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-hydroxypropanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(2,5-dimethoxyphenyl)-3-hydroxy-propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(CO)C(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO6/c1-28-17-10-11-21(29-2)18(13-17)19(14-25)22(26)24-12-6-9-20(24)23(27)30-15-16-7-4-3-5-8-16/h3-5,7-8,10-11,13,19-20,25H,6,9,12,14-15H2,1-2H3/t19-,20+/m1/s1